element(s):
['C']
AFLOW prototype label:
A_tI8_139_h
Parameter names:
['a', 'c/a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.3798', '0.57333668', '0.81976373']
model name:
MEAM_LAMMPS_Lee_2006_FeC__MO_856956178669_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0.81976373 0.81976373 0.        ]]
spacegroup =  139
cell =  [[4.3798, 0, 0], [0, 4.3798, 0], [0, 0, 2.5111]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:17:13      -55.521875        7.3948
BFGS:    1 17:17:13      -57.196283        2.0954
BFGS:    2 17:17:13      -57.303064        1.8930
BFGS:    3 17:17:13      -57.430410        1.5251
BFGS:    4 17:17:13      -57.528920        1.1355
BFGS:    5 17:17:13      -57.597728        0.7268
BFGS:    6 17:17:13      -57.635145        0.2966
BFGS:    7 17:17:13      -57.642016        0.0102
BFGS:    8 17:17:13      -57.642022        0.0066
BFGS:    9 17:17:14      -57.642025        0.0074
BFGS:   10 17:17:14      -57.642031        0.0061
BFGS:   11 17:17:14      -57.642033        0.0033
BFGS:   12 17:17:14      -57.642034        0.0014
BFGS:   13 17:17:14      -57.642034        0.0003
BFGS:   14 17:17:14      -57.642034        0.0000
BFGS:   15 17:17:14      -57.642034        0.0000
BFGS:   16 17:17:14      -57.642034        0.0000
BFGS:   17 17:17:14      -57.642034        0.0000
BFGS:   18 17:17:14      -57.642034        0.0000
Minimization converged after 18 steps.
Maximum force component: 4.2096922461042094e-10 eV/Angstrom
Maximum stress component: 4.1753002469162755e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[8.10542522e-01 8.10542522e-01 3.17819932e-34]
 [1.89457478e-01 1.89457478e-01 7.94549830e-35]
 [1.89457478e-01 8.10542522e-01 3.17819932e-34]
 [8.10542522e-01 1.89457478e-01 1.58909966e-34]
 [3.10542522e-01 3.10542522e-01 5.00000000e-01]
 [6.89457478e-01 6.89457478e-01 5.00000000e-01]
 [6.89457478e-01 3.10542522e-01 5.00000000e-01]
 [3.10542522e-01 6.89457478e-01 5.00000000e-01]]
cellpar =  Cell([[4.4606340508195546, -2.0926451254654513e-35, 3.811164688275826e-33], [-4.021476050020711e-36, 4.4606340508195546, 2.5005691236668253e-18], [-8.211920057124348e-33, 1.4041658098708632e-18, 2.423925939708091]])
forces =  [[-4.20969225e-10 -4.20969225e-10 -2.35899834e-28]
 [ 4.20969225e-10  4.20969225e-10  2.36228483e-28]
 [ 4.20969225e-10 -4.20969225e-10 -2.36153790e-28]
 [-4.20969225e-10  4.20969225e-10  2.35989465e-28]
 [-4.20969225e-10 -4.20969225e-10 -2.35929711e-28]
 [ 4.20969225e-10  4.20969225e-10  2.36133920e-28]
 [ 4.20969225e-10 -4.20969225e-10 -2.36108974e-28]
 [-4.20969225e-10  4.20969225e-10  2.35944650e-28]]
stress =  [ 2.81317931e-10  2.81317931e-10  4.17530025e-10 -1.61762315e-26
  1.13999913e-33 -5.77892350e-50]
energy per atom =  -7.2052542888844275
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0